Geometry & MOs

Info

ID:	351745
PubChem CID:	127282145
Reduced:	O3N4C22H28 (1)
Stoich.:	A3B4C22D28 (1)
Weight, g/mol:	387.198048
ΔH_f, kcal/mol:	-110.36
Dipole, Da:	5.54
IP(EA), eV:	-8.96(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[4-(2,3-dihydro-1-benzothiophene-2-carbonyl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCCC1)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4NC3=O

DOS

IR

Vibrations